60187410 -OEChem-04232411532D 81 85 0 1 0 0 0 0 0999 V2000 6.6115 -0.6401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8186 -1.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6774 -5.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3598 1.4687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7596 2.1316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1938 -2.8131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0363 -3.9779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9856 0.4143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 -1.3472 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6115 -0.6401 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.0598 -2.3131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4526 -3.7790 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9942 0.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2846 -1.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -3.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -2.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 -2.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6425 -3.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -1.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 -1.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0476 -4.0810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -1.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4185 -4.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7455 -4.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7041 -4.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6144 -3.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4695 -0.9993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4527 -4.9285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2616 0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5944 -0.3790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3683 1.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -4.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4614 0.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3635 0.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7425 2.3926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1337 3.1860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7339 2.5231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5164 4.1098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1166 3.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5078 4.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8905 5.1642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4791 -0.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2671 -0.1246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2203 -2.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6798 -2.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8537 -3.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0212 0.9032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3889 0.4180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 -1.6872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8834 -0.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1241 -0.4895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8015 -2.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6485 -1.8161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0362 -3.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4726 -3.4202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -4.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -4.9246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1839 -4.9246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2427 -5.1363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1182 -5.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1656 -4.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3683 -2.4809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9362 -1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7119 -5.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 0.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1025 -0.7565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9718 -0.8709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0863 -0.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3836 -3.8168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0599 -5.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9233 0.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3659 1.1832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2762 -5.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 3.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1113 2.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 4.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7313 3.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4633 4.9270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1278 5.7371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3177 5.4015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 19 1 0 0 0 0 2 16 2 0 0 0 0 3 23 1 0 0 0 0 3 74 1 0 0 0 0 4 31 1 0 0 0 0 4 36 1 0 0 0 0 5 31 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 7 15 1 0 0 0 0 7 21 1 0 0 0 0 7 25 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 6 0 0 0 9 43 1 0 0 0 0 10 13 1 6 0 0 0 10 44 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 1 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 26 2 0 0 0 0 19 22 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 22 1 0 0 0 0 20 27 2 0 0 0 0 21 28 2 0 0 0 0 22 29 2 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 32 1 0 0 0 0 26 63 1 0 0 0 0 27 34 1 0 0 0 0 27 64 1 0 0 0 0 28 33 1 0 0 0 0 28 65 1 0 0 0 0 29 35 1 0 0 0 0 29 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 32 33 2 0 0 0 0 32 70 1 0 0 0 0 33 71 1 0 0 0 0 34 35 2 0 0 0 0 34 72 1 0 0 0 0 35 73 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 37 39 1 0 0 0 0 37 75 1 0 0 0 0 38 40 2 0 0 0 0 38 76 1 0 0 0 0 39 41 2 0 0 0 0 39 77 1 0 0 0 0 40 41 1 0 0 0 0 40 78 1 0 0 0 0 41 42 1 0 0 0 0 42 79 1 0 0 0 0 42 80 1 0 0 0 0 42 81 1 0 0 0 0 M END > 60187410 > 1 > 910 > 5 > 1 > 6 > AAADcfB/OAAAAAAAAAAAAAAAAAAAAWAAAAAwYMAAAAAAAFgB9AAAHgAACAAADTzhngYyzvMMFgCoAyVyXACCiCAnIiAI2CG+bNgOdvLEtbufcyhmxhHY6QeY2fOeoAAAAAASAABAAAAAACQAAAAAAAAAAA== > p-tolyl N-[[(10S,11R)-13-[(1R)-2-hydroxy-1-methyl-ethyl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N-methyl-carbamate > N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N-methylcarbamic acid (4-methylphenyl) ester > (4-methylphenyl) N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N-methylcarbamate > (4-methylphenyl) N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N-methylcarbamate > (4-methylphenyl) N-[[(10S,11R)-11,16-dimethyl-14-oxidanylidene-13-[(2R)-1-oxidanylpropan-2-yl]-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N-methyl-carbamate > N-[[(10S,11R)-13-[(1R)-2-hydroxy-1-methyl-ethyl]-14-keto-11,16-dimethyl-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N-methyl-carbamic acid p-tolyl ester > InChI=1S/C34H39N3O5/c1-22-14-16-26(17-15-22)42-34(40)35(4)19-30-23(2)18-37(24(3)20-38)33(39)32-31(27-11-7-6-10-25(27)21-41-30)28-12-8-9-13-29(28)36(32)5/h6-17,23-24,30,38H,18-21H2,1-5H3/t23-,24-,30-/m1/s1 > QTCNHWMCPMTVQP-BOYVUMAVSA-N > 5.3 > 569.28897135 > C34H39N3O5 > 569.7 > CC1CN(C(=O)C2=C(C3=CC=CC=C3COC1CN(C)C(=O)OC4=CC=C(C=C4)C)C5=CC=CC=C5N2C)C(C)CO > C[C@@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)OC4=CC=C(C=C4)C)C5=CC=CC=C5N2C)[C@H](C)CO > 84.2 > 569.28897135 > 0 > 42 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 13 6 12 24 5 15 17 8 17 18 8 18 21 8 18 26 8 20 22 8 20 27 8 21 28 8 22 29 8 26 32 8 27 34 8 28 33 8 29 35 8 32 33 8 34 35 8 36 37 8 36 38 8 37 39 8 38 40 8 39 41 8 40 41 8 7 15 8 7 21 8 9 14 6 $$$$